1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine

C10H18N2 — CID 91431640

IUPAC1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine
SMILESC/N=C1\C/C(=N\C)CC(C)(C)C1
InChIInChI=1S/C10H18N2/c1-10(2)6-8(11-3)5-9(7-10)12-4/h5-7H2,1-4H3/b11-8+,12-9+
InChIKeyOSKUQVVERYUHHJ-HZOWPXDZSA-N
MW166.27 g/mol
LogP2.34
Rot. Bonds

About 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine

1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine (PubChem CID 91431640) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine.

Molecular Properties

Compound Name1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine
PubChem CID91431640
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine
SMILESC/N=C1\C/C(=N\C)CC(C)(C)C1
InChIInChI=1S/C10H18N2/c1-10(2)6-8(11-3)5-9(7-10)12-4/h5-7H2,1-4H3/b11-8+,12-9+
InChIKeyOSKUQVVERYUHHJ-HZOWPXDZSA-N
XLogP2.34
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-2-azaspiro[4.5]dec-1-ene
CID 101961579
6-butyl-5,5-dimethyl-3,4-dihydro-2H-pyridine
CID 11286681
3-Propyl-2-azaspiro[4.5]dec-2-ene
CID 102196249
cis-(2R,4S)-4-tert-butyl-2-methyl-N-propylcyclohexan-1-imine
CID 134889524
cis-(2S,4R)-4-tert-butyl-2-methyl-N-propylcyclohexan-1-imine
CID 134889557
trans-(2R,6R)-4-tert-butyl-2,6-dimethyl-N-propylcyclohexan-1-imine
CID 134905587
cis-(2S,6R)-4-tert-butyl-2,6-dimethyl-N-propylcyclohexan-1-imine
CID 134975677
3,6-diethyl-3-methyl-4,5-dihydro-2H-pyridine
CID 134987327
trans-(2R,4R)-4-tert-butyl-2-methyl-N-propylcyclohexan-1-imine
CID 135050335
N,2,2-trimethylcyclohexan-1-imine
CID 12526247
N-hexyl-3,3,5-trimethylcyclohexan-1-imine
CID 13488945
2-N,7-N,3,3,4,4,5,5,6,6-decamethyloctane-2,7-diimine
CID 20658921

Frequently Asked Questions

What is the IUPAC name of 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine?
The IUPAC name of 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine (CID 91431640) is 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine.
What is the SMILES notation for 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine?
The canonical SMILES for 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine is C/N=C1\C/C(=N\C)CC(C)(C)C1.
What is the InChIKey of 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine?
The InChIKey is OSKUQVVERYUHHJ-HZOWPXDZSA-N. The full InChI is InChI=1S/C10H18N2/c1-10(2)6-8(11-3)5-9(7-10)12-4/h5-7H2,1-4H3/b11-8+,12-9+.
What are the key properties of 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine?
1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine has a molecular weight of 166.27 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,3-N,5,5-tetramethylcyclohexane-1,3-diimine is sourced from PubChem (CID 91431640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).